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(Q82915997)
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English
8-[(2R)-2,3-dihydroxy-3-methylbutyl]-5,7-dimethoxychromen-2-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Isomexoticin
1 reference
based on heuristic
inferred from SMILES
mass
308.12598836
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
8-[(2S)-2,3-dihydroxy-3-methylbutyl]-5,7-dimethoxychromen-2-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₆H₂₀O₆
0 references
canonical SMILES
O=C1OC2=C(C=C1)C(OC)=CC(OC)=C2CC(O)C(O)(C)C
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isomeric SMILES
CC(C)([C@@H](CC1=C(C=C(C2=C1OC(=O)C=C2)OC)OC)O)O
0 references
found in taxon
Merrillia caloxylon
1 reference
stated in
Coumarins of Merrillia caloxylon
Murraya alata
1 reference
stated in
Anti-inflammatory coumarin and benzocoumarin derivatives from Murraya alata
Murraya caloxylon
1 reference
stated in
Coumarins of Merrillia caloxylon
pomelo
1 reference
stated in
Systematic chemical profiling of Citrus grandis 'Tomentosa' by ultra-fast liquid chromatography/diode-array detector/quadrupole time-of-flight tandem mass spectrometry
Citrus grandis
1 reference
stated in
Systematic chemical profiling of Citrus grandis 'Tomentosa' by ultra-fast liquid chromatography/diode-array detector/quadrupole time-of-flight tandem mass spectrometry
Murraya exotica
7 references
stated in
A chemotaxonomic division of Murraya based on the distribution of the alkaloids yuehchukene and girinimbine
stated in
Indole alkaloids and coumarins from the root bark of Murraya paniculata var. Omphalocarpa
stated in
Coumarins from the leaves of Murraya paniculata
stated in
The chemical composition of Murraya paniculata. The structure of five new coumarins and one new alkaloid and the stereochemistry of murrangatin and related coumarins
stated in
Prenylcoumarins from Murraya paniculata var. omphalocarpa(Rutaceae): The Absolute Configuration of Sibiricin, Mexoticin and Omphamurin.
stated in
Constituents of the root bark of Murraya paniculata collected in Indonesia.
stated in
Anti-inflammatory coumarin and benzocoumarin derivatives from Murraya alata
Murraya gleniei
1 reference
stated in
Gleinene and gleinadiene, 5,7-dimethoxycoumarins from Murraya gleinei root
Murraya paniculata
7 references
stated in
Coumarins from the leaves of Murraya paniculata
stated in
Anti-inflammatory coumarin and benzocoumarin derivatives from Murraya alata
stated in
The chemical composition of Murraya paniculata. The structure of five new coumarins and one new alkaloid and the stereochemistry of murrangatin and related coumarins
stated in
Constituents of the root bark of Murraya paniculata collected in Indonesia.
stated in
Indole alkaloids and coumarins from the root bark of Murraya paniculata var. Omphalocarpa
stated in
Prenylcoumarins from Murraya paniculata var. omphalocarpa(Rutaceae): The Absolute Configuration of Sibiricin, Mexoticin and Omphamurin.
stated in
A chemotaxonomic division of Murraya based on the distribution of the alkaloids yuehchukene and girinimbine
Identifiers
InChI
InChI=1S/C16H20O6/c1-16(2,19)13(17)7-10-12(21-4)8-11(20-3)9-5-6-14(18)22-15(9)10/h5-6,8,13,17,19H,7H2,1-4H3/t13-/m1/s1
0 references
InChIKey
JVCJUTNJQMKKCK-CYBMUJFWSA-N
0 references
CAS Registry Number
18196-00-4
0 references
PubChem CID
176970
1 reference
matched by identifier from
InChIKey
InChIKey
JVCJUTNJQMKKCK-CYBMUJFWSA-N
UniChem compound ID
4378262
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30939511
1 reference
matched by identifier from
InChIKey
InChIKey
JVCJUTNJQMKKCK-CYBMUJFWSA-N
DSSTOX compound identifier
DTXCID901368006
0 references
Probes And Drugs ID
PD165390
0 references
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